Home Carboxys 6,6-dimethyl-1H,4H,6H-furo[3,4-c]pyrazole-3-carboxylic acid

6,6-dimethyl-1H,4H,6H-furo[3,4-c]pyrazole-3-carboxylic acid

CAS No.:
1933596-07-6
Catalog Number:
AG01DW3S
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DW3S
Chemical Name:
6,6-dimethyl-1H,4H,6H-furo[3,4-c]pyrazole-3-carboxylic acid
CAS Number:
1933596-07-6
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
IUPAC Name:
6,6-dimethyl-1,4-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid
InChI:
InChI=1S/C8H10N2O3/c1-8(2)6-4(3-13-8)5(7(11)12)9-10-6/h3H2,1-2H3,(H,9,10)(H,11,12)
InChI Key:
XBMYGSKRORVPNY-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c2c1COC2(C)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties